N-[2-methyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-methyl-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-(4-benzylpiperidine-1-carbonyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-methyl-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-(4-benzylpiperidine-1-carbonyl)-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-(4-benzylpiperidine-1-carbonyl)-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)NC(=O)C4=CSCCO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)NC(=O)C4=CSCCO4

InChI

InChI=1S/C25H28N2O3S/c1-18-7-8-21(16-22(18)26-24(28)23-17-31-14-13-30-23)25(29)27-11-9-20(10-12-27)15-19-5-3-2-4-6-19/h2-8,16-17,20H,9-15H2,1H3,(H,26,28)